7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione

C179H183B5Br3N9O42S — CID 160682192

About 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione

7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione (PubChem CID 160682192) has the molecular formula C179H183B5Br3N9O42S and a molecular weight of 3458.29 g/mol. Its IUPAC name is 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione.

Molecular Properties

• Compound Name: 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione
• PubChem CID: 160682192
• Molecular Formula: C179H183B5Br3N9O42S
• Molecular Weight: 3458.29 g/mol
• Exact Mass: 3454.02
• IUPAC Name: 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione
• SMILES: CC1(C)OB(c2ccc(OC3COc4c(Br)cccc43)cc2)OC1(C)C.CN1CC(=O)OB(c2ccc(O[C@@H]3CCc4c(Oc5ccc(C(=O)N6CCCC6)cc5)cccc43)cc2)OC(=O)C1.COCCN(C)C(=O)c1ccc(Oc2cccc3c2CC[C@H]3Oc2ccc(B3OC(=O)CN(C)CC(=O)O3)cc2)cc1.COc1cccc(Oc2cccc3c2CC[C@@H]3O)n1.COc1cccc(Oc2cccc3c2CC[C@H]3Oc2ccc(B3OC(=O)CN(C)CC(=O)O3)cc2)n1.Cc1nc(OCCC(C)(C)O)ccc1Oc1cccc2c1OCC2Oc1ccc(B2OC(C)(C)C(C)(C)O2)cc1.O=C1C=C(c2ccc(OC3COc4c(Br)cccc43)cc2)S(=O)N1.OC1COc2c(Br)cccc21
• InChI: InChI=1S/C31H33BN2O8.C31H31BN2O7.C31H38BNO7.C26H25BN2O7.C20H22BBrO4.C17H12BrNO4S.C15H15NO3.C8H7BrO2/c1-33-19-29(35)41-32(42-30(36)20-33)22-9-13-24(14-10-22)40-28-16-15-26-25(28)5-4-6-27(26)39-23-11-7-21(8-12-23)31(37)34(2)17-18-38-3;1-33-19-29(35)40-32(41-30(36)20-33)22-9-13-24(14-10-22)39-28-16-15-26-25(28)5-4-6-27(26)38-23-11-7-21(8-12-23)31(37)34-17-2-3-18-34;1-20-24(15-16-27(33-20)35-18-17-29(2,3)34)38-25-10-8-9-23-26(19-36-28(23)25)37-22-13-11-21(12-14-22)32-39-30(4,5)31(6,7)40-32;1-29-15-25(30)35-27(36-26(31)16-29)17-9-11-18(12-10-17)33-22-14-13-20-19(22)5-3-6-21(20)34-24-8-4-7-23(28-24)32-2;1-19(2)20(3,4)26-21(25-19)13-8-10-14(11-9-13)24-17-12-23-18-15(17)6-5-7-16(18)22;18-13-3-1-2-12-14(9-22-17(12)13)23-11-6-4-10(5-7-11)15-8-16(20)19-24(15)21;1-18-14-6-3-7-15(16-14)19-13-5-2-4-10-11(13)8-9-12(10)17;9-6-3-1-2-5-7(10)4-11-8(5)6/h4-14,28H,15-20H2,1-3H3;4-14,28H,2-3,15-20H2,1H3;8-16,26,34H,17-19H2,1-7H3;3-12,22H,13-16H2,1-2H3;5-11,17H,12H2,1-4H3;1-8,14H,9H2,(H,19,20);2-7,12,17H,8-9H2,1H3;1-3,7,10H,4H2/t2*28-;;22-;;;12-;/m11.1..0./s1
• InChIKey: ROHGEBPZVOCQKE-CSCBSDHVSA-N
• XLogP: 26.80
• TPSA: 565.96 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 48
• Rotatable Bonds: 39
• Heavy Atoms: 239
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3458.29
LogP ≤ 5	26.80
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	48

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione?

The IUPAC name of 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione (CID 160682192) is 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione.

What is the SMILES notation for 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione?

The canonical SMILES for 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione is CC1(C)OB(c2ccc(OC3COc4c(Br)cccc43)cc2)OC1(C)C.CN1CC(=O)OB(c2ccc(O[C@@H]3CCc4c(Oc5ccc(C(=O)N6CCCC6)cc5)cccc43)cc2)OC(=O)C1.COCCN(C)C(=O)c1ccc(Oc2cccc3c2CC[C@H]3Oc2ccc(B3OC(=O)CN(C)CC(=O)O3)cc2)cc1.COc1cccc(Oc2cccc3c2CC[C@@H]3O)n1.COc1cccc(Oc2cccc3c2CC[C@H]3Oc2ccc(B3OC(=O)CN(C)CC(=O)O3)cc2)n1.Cc1nc(OCCC(C)(C)O)ccc1Oc1cccc2c1OCC2Oc1ccc(B2OC(C)(C)C(C)(C)O2)cc1.O=C1C=C(c2ccc(OC3COc4c(Br)cccc43)cc2)S(=O)N1.OC1COc2c(Br)cccc21.

What is the InChIKey of 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione?

The InChIKey is ROHGEBPZVOCQKE-CSCBSDHVSA-N. The full InChI is InChI=1S/C31H33BN2O8.C31H31BN2O7.C31H38BNO7.C26H25BN2O7.C20H22BBrO4.C17H12BrNO4S.C15H15NO3.C8H7BrO2/c1-33-19-29(35)41-32(42-30(36)20-33)22-9-13-24(14-10-22)40-28-16-15-26-25(28)5-4-6-27(26)39-23-11-7-21(8-12-23)31(37)34(2)17-18-38-3;1-33-19-29(35)40-32(41-30(36)20-33)22-9-13-24(14-10-22)39-28-16-15-26-25(28)5-4-6-27(26)38-23-11-7-21(8-12-23)31(37)34-17-2-3-18-34;1-20-24(15-16-27(33-20)35-18-17-29(2,3)34)38-25-10-8-9-23-26(19-36-28(23)25)37-22-13-11-21(12-14-22)32-39-30(4,5)31(6,7)40-32;1-29-15-25(30)35-27(36-26(31)16-29)17-9-11-18(12-10-17)33-22-14-13-20-19(22)5-3-6-21(20)34-24-8-4-7-23(28-24)32-2;1-19(2)20(3,4)26-21(25-19)13-8-10-14(11-9-13)24-17-12-23-18-15(17)6-5-7-16(18)22;18-13-3-1-2-12-14(9-22-17(12)13)23-11-6-4-10(5-7-11)15-8-16(20)19-24(15)21;1-18-14-6-3-7-15(16-14)19-13-5-2-4-10-11(13)8-9-12(10)17;9-6-3-1-2-5-7(10)4-11-8(5)6/h4-14,28H,15-20H2,1-3H3;4-14,28H,2-3,15-20H2,1H3;8-16,26,34H,17-19H2,1-7H3;3-12,22H,13-16H2,1-2H3;5-11,17H,12H2,1-4H3;1-8,14H,9H2,(H,19,20);2-7,12,17H,8-9H2,1H3;1-3,7,10H,4H2/t2*28-;;22-;;;12-;/m11.1..0./s1.

What are the key properties of 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione?

7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione has a molecular weight of 3458.29 g/mol, XLogP of 26.80, 39 rotatable bonds, 4 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-2,3-dihydro-1-benzofuran-3-ol;5-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-1-oxo-1,2-thiazol-3-one;2-[4-[(7-bromo-2,3-dihydro-1-benzofuran-3-yl)oxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;N-(2-methoxyethyl)-N-methyl-4-[[(1R)-1-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenoxy]-2,3-dihydro-1H-inden-4-yl]oxy]benzamide;(1S)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-ol;2-[4-[[(1R)-4-[(6-methoxy-2-pyridinyl)oxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;2-methyl-4-[[6-methyl-5-[[3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2,3-dihydro-1-benzofuran-7-yl]oxy]-2-pyridinyl]oxy]butan-2-ol;6-methyl-2-[4-[[(1R)-4-[4-(pyrrolidine-1-carbonyl)phenoxy]-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3,6,2-dioxazaborocane-4,8-dione is sourced from PubChem (CID 160682192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).